CID 24846433

9-tetradecenamide, n-((4-hydroxy-3-methoxyphenyl)methyl)-, (z)-

Structural Information

Molecular Formula
C22H35NO3
SMILES
CCCC/C=C\CCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC
InChI
InChI=1S/C22H35NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-22(25)23-18-19-15-16-20(24)21(17-19)26-2/h6-7,15-17,24H,3-5,8-14,18H2,1-2H3,(H,23,25)/b7-6-
InChIKey
MPJJUXAOMCGCAB-SREVYHEPSA-N
Compound name
(Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]tetradec-9-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

361.2617 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.268976 194.4
[M+Na]+ 384.250918 197.0
[M-H]- 360.254424 194.8
[M+NH4]+ 379.295523 206.3
[M+K]+ 400.224858 192.0
[M+H-H2O]+ 344.258960 186.1
[M+HCOO]- 406.259901 214.1
[M+CH3COO]- 420.275551 219.0
[M+Na-2H]- 382.236366 192.8
[M]+ 361.26115142 199.2
[M]- 361.26224858 199.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe